Dataset

6d[6d-H.jdx]

This dataset contains NMR spectra obtained for the sample -6d date: 2023/01/03 09:46:30.000 isFt: true name: 6d-C type: NMR SPECTRUM isFid: false lastX: -522.7639307445279 title: LJC-112-9-B.2.fid firstX: 30727.236069255472 nucleus: 13C solvent: CDCl3 dataClass: XYDATA dimension: 1 isComplex: false experiment: 1d pulseSequence: zgpg30 numberOfPoints: 65536 acquisitionMode: SIMULTANEOUS (DQD) originFrequency: 125.782939 acquisitionScheme: undefined date: 2023/01/03 09:44:25.000 isFt: true name: 6d-H type: NMR SPECTRUM isFid: false lastX: -767.575007509668 title: LJC-112-9-B.1.fid firstX: 8246.848069413432 nucleus: 1H solvent: CDCl3 dataClass: XYDATA dimension: 1 isComplex: false experiment: 1d pulseSequence: zg30 numberOfPoints: 65536 acquisitionMode: SIMULTANEOUS (DQD) originFrequency: 500.173751275 acquisitionScheme: undefined

Chemical Information

molecular Image
InChI InChI=1S/C22H20O/c1-16-8-7-11-18(14-16)20-15-22(17-9-3-2-4-10-17)23-21-13-6-5-12-19(20)21/h2-14,20,22H,15H2,1H3
SMILES CC1=CC(C2CC(C3=CC=CC=C3)OC3=CC=CC=C32)=CC=C1
InChI Key ZSWFVLUHJWSRFC-UHFFFAOYSA-N

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p116.s1210.d5206
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D5206
Version
Author
Maintainer
Language english
MetadataPublished 2025-05-30T12:26:38.000000Z
Related Molecule
  • nfdi4chem-mol7681 (Unknown Molecule)
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    NMR solvent : CDCl3

    acquisition nucleus : ['1H']

    NMR spectrum by dimensionality : 1

    NMR probe :

    Temperature : K

    magnetic field strength : Tesla

    number of scans : scans

    nuclear magnetic resonance pulse sequence : zg30

    Spectral Width :

    number of data points : 65536 points

    relaxation time measurement : seconds

    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.